1-[2-[[3-[[4-(2-methanoylhydrazinyl)phenyl]sulfamoyl]-2,6-dimethyl-phenyl]amino]-2-oxidanylidene-ethyl]-N-[6-[[1-[2-[[3-[[4-(2-methanoylhydrazinyl)phenyl]sulfamoyl]-2,6-dimethyl-phenyl]amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-yl]methoxy-methyl-amino]hexyl]-N-methyl-pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[2-[[3-[[4-(2-methanoylhydrazinyl)phenyl]sulfamoyl]-2,6-dimethyl-phenyl]amino]-2-oxidanylidene-ethyl]-N-[6-[[1-[2-[[3-[[4-(2-methanoylhydrazinyl)phenyl]sulfamoyl]-2,6-dimethyl-phenyl]amino]-2-oxidanylidene-ethyl]pyridin-1-ium-3-yl]methoxy-methyl-amino]hexyl]-N-methyl-pyridin-1-ium-3-carboxamide Openeye Name: 1-[2-[3-[[4-(2-formylhydrazino)phenyl]sulfamoyl]-2,6-dimethyl-anilino]-2-oxo-ethyl]-N-[6-[[1-[2-[3-[[4-(2-formylhydrazino)phenyl]sulfamoyl]-2,6-dimethyl-anilino]-2-oxo-ethyl]pyridin-1-ium-3-yl]methoxy-methyl-amino]hexyl]-N-methyl-pyridin-1-ium-3-carboxamide CAS Name: 1-[2-[3-[[4-(formylhydrazo)phenyl]sulfamoyl]-2,6-dimethylanilino]-2-oxoethyl]-N-[6-[[1-[2-[3-[[4-(formylhydrazo)phenyl]sulfamoyl]-2,6-dimethylanilino]-2-oxoethyl]-3-pyridin-1-iumyl]methoxy-methylamino]hexyl]-N-methyl-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[2-[3-[[4-(2-formylhydrazinyl)phenyl]sulfamoyl]-2,6-dimethylanilino]-2-oxoethyl]-N-[6-[[1-[2-[3-[[4-(2-formylhydrazinyl)phenyl]sulfamoyl]-2,6-dimethylanilino]-2-oxoethyl]pyridin-1-ium-3-yl]methoxy-methylamino]hexyl]-N-methylpyridin-1-ium-3-carboxamide Traditional Name: 1-[2-[3-[[4-(N'-formylhydrazino)phenyl]sulfamoyl]-2,6-dimethyl-anilino]-2-keto-ethyl]-N-[6-[[1-[2-[3-[[4-(N'-formylhydrazino)phenyl]sulfamoyl]-2,6-dimethyl-anilino]-2-keto-ethyl]pyridin-1-ium-3-yl]methoxy-methyl-amino]hexyl]-N-methyl-pyridin-1-ium-3-carboxamide Formula: C54H66N12O10S2+2 MolecularWeight: 1107.30624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NNC=O)C)NC(=O)C[N+]3=CC=CC(=C3)CON(C)CCCCCCN(C)C(=O)C4=C[N+](=CC=C4)CC(=O)NC5=C(C=CC(=C5C)S(=O)(=O)NC6=CC=C(C=C6)NNC=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NNC=O)C)NC(=O)C[N+]3=CC=CC(=C3)CON(C)CCCCCCN(C)C(=O)C4=C[N+](=CC=C4)CC(=O)NC5=C(C=CC(=C5C)S(=O)(=O)NC6=CC=C(C=C6)NNC=O)C

InChI

InChI=1S/C54H64N12O10S2/c1-38-15-25-48(77(72,73)61-46-21-17-44(18-22-46)59-55-36-67)40(3)52(38)57-50(69)33-65-29-11-13-42(31-65)35-76-64(6)28-10-8-7-9-27-63(5)54(71)43-14-12-30-66(32-43)34-51(70)58-53-39(2)16-26-49(41(53)4)78(74,75)62-47-23-19-45(20-24-47)60-56-37-68/h11-26,29-32,36-37,59-62H,7-10,27-28,33-35H2,1-6H3,(H2-2,55,56,57,58,67,68,69,70)/p+2